Information card for entry 2009964

Structure parameters

• Formula: C26 H34 O4
• Calculated formula: C26 H34 O4
• SMILES: O=C(C(=O)Oc1ccccc1)Oc1c(cc(cc1C(C)(C)C)C(C)(C)C)C(C)(C)C
• Title of publication: Substituted diphenyl oxalates
• Authors of publication: George, C.; Lahti, P. M.; Modarelli, D. A.; Inceli, A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 8
• Pages of publication: 1308 - 1312
• a: 9.902 ± 0.001 Å
• b: 10.012 ± 0.001 Å
• c: 12.512 ± 0.002 Å
• α: 88.05 ± 0.02°
• β: 83.27 ± 0.02°
• γ: 84.69 ± 0.02°
• Cell volume: 1226.3 ± 0.3 ų
• Cell temperature: 293 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.066
• Weighted residual factors for significantly intense reflections: 0.088
• Goodness-of-fit parameter for significantly intense reflections: 2.31
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No